Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 5/20 | 0.62 |
| ▸ | MAOB | P27338 | 3/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | ACHE | P22303 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28809438 | 1.00 | BCHE (0.62) | BCHEMAOBALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL8948755 | 0.86 | S1PR5 (0.53) | BCHEMAOBALDH1A1L3MBTL1 | |
| SCHEMBL23582348 | 0.84 | BCHE (0.56) | BCHEMAOBALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL28809413 | 0.84 | BCHE (0.56) | BCHEMAOBALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL8948613 | 0.83 | L3MBTL1 (0.60) | BCHEACHEL3MBTL1 | |
| SCHEMBL19779511 | 0.83 | ALDH1A1 (0.63) | BCHEMAOBALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL28187918 | 0.83 | ALDH1A1 (0.63) | BCHEMAOBALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL20012547 | 0.82 | BCHE (0.62) | BCHEMAOBALDH1A1CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL7302953 | 0.82 | L3MBTL1 (0.59) | BCHEACHEL3MBTL1SMN1; SMN2 | |
| SCHEMBL19038337 | 0.81 | BCHE (0.72) | BCHEMAOBALDH1A1CYP3A4CYP2D6 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114846013-A | Novel aminoaryl derivatives useful as diacylglycerol acyltransferase 2 inhibitors and uses thereof | 株式会社LG化学 | 2022-08-02 | — | — | CN | disclosed |
| US-5532255-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1996-07-02 | — | — | US | disclosed |